COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK105333
Chemical Name: tetramethyl2'-ethoxy-7',7'-dimethyl-4',5'-dioxo-4',5'-dihydro-7'H-spiro[1,3-dithiole-2,11'-pyrrolo[3,2,1-ij]thiopyrano[2,3-c]quinoline]-4,5,9',10'-tetracarboxylate
Smiles: CCOc1cc2C(=O)C(=O)N3c2c(c1)C1=C(C3(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC

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Molecular Weight: 647.7
Empirical Formula: C28H25NO11S3

Physical State: Dry powder
Available Amount: 460 mg

Lipinsky:
logP: 8.872
Rotatable bonds: 10
H-donors: 0
H-acceptors: 11
PSA: 227
Number of rings: 5

     

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